Methyl 2-(2,5-dimethylphenoxy)acetate
TL;DR: Methyl 2-(2,5-dimethylphenoxy)acetate (CAS 95450-80-9) is a chemical compound with molecular formula C11H14O3 and molecular weight 194.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(2,5-dimethylphenoxy)acetate
Also Known As: methyl 2-(2,5-dimethylphenoxy)acetate, TimTec1_003128, methyl (2,5-dimethylphenoxy)acetate, methyl 2,5-dimethylphenoxyacetate, 2,5-Dimethylphenoxyacetic acid methyl ester
| Molecular Formula | C11H14O3 |
|---|---|
| Molecular Weight | 194.09 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 194.0943 |
| Heavy Atoms | 14 |
| Complexity | 191.0 |
Chemical Identifiers
| CAS Number | 95450-80-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)OCC(=O)OC |
| InChIKey | MJHCVYQQBIXYGN-UHFFFAOYSA-N |
Product Overview
Methyl 2-(2,5-dimethylphenoxy)acetate (CAS 95450-80-9), with molecular formula C11H14O3 and molecular weight 194.09 g/mol. IUPAC: methyl 2-(2,5-dimethylphenoxy)acetate.
Chemical Property Profile of Methyl 2-(2,5-dimethylphenoxy)acetate
Property Insights of Methyl 2-(2,5-dimethylphenoxy)acetate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-(2,5-dimethylphenoxy)acetate. With a topological polar surface area (TPSA) of 35.5 Ų, Methyl 2-(2,5-dimethylphenoxy)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-(2,5-dimethylphenoxy)acetate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl 2-(2,5-dimethylphenoxy)acetate?
The CAS number of Methyl 2-(2,5-dimethylphenoxy)acetate is 95450-80-9.
What is the molecular formula of Methyl 2-(2,5-dimethylphenoxy)acetate?
The molecular formula of Methyl 2-(2,5-dimethylphenoxy)acetate is C11H14O3.
What is the molecular weight of Methyl 2-(2,5-dimethylphenoxy)acetate?
The molecular weight of Methyl 2-(2,5-dimethylphenoxy)acetate is 194.09 g/mol.
Where can I buy Methyl 2-(2,5-dimethylphenoxy)acetate?
You can request a quote for Methyl 2-(2,5-dimethylphenoxy)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-(2,5-dimethylphenoxy)acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-(2,5-dimethylphenoxy)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.